Geometry & MOs

Info

ID:	289997
PubChem CID:	104396759
Reduced:	ON2C16H26 (1)
Stoich.:	AB2C16D26 (1)
Weight, g/mol:	264.220164
ΔH_f, kcal/mol:	-45.71
Dipole, Da:	3.37
IP(EA), eV:	-8.72(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-N-tert-butyl-2-N-[2-(3-methoxyphenyl)ethyl]propane-1,2-diamine

Drug info:

PubChemData

Smile

CC(CNC(C)(C)C)NCC1COC2=CC=CC=C12

DOS

IR

Vibrations